N-cyclohexyl-2-[(2R)-3-oxidanylidene-1-phenethyl-piperazin-1-ium-2-yl]-N-prop-2-ynyl-ethanamide

Systemtic Name: N-cyclohexyl-2-[(2R)-3-oxidanylidene-1-phenethyl-piperazin-1-ium-2-yl]-N-prop-2-ynyl-ethanamide Openeye Name: N-cyclohexyl-2-[(2R)-3-oxo-1-phenethyl-piperazin-1-ium-2-yl]-N-prop-2-ynyl-acetamide CAS Name: N-cyclohexyl-2-[(2R)-3-oxo-1-phenethyl-2-piperazin-1-iumyl]-N-prop-2-ynylacetamide IUPAC Name: N-cyclohexyl-2-[(2R)-3-oxo-1-phenethylpiperazin-1-ium-2-yl]-N-prop-2-ynylacetamide Traditional Name: N-cyclohexyl-2-[(2R)-3-keto-1-phenethyl-piperazin-1-ium-2-yl]-N-propargyl-acetamide Formula: C23H32N3O2+ MolecularWeight: 382.51908

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Descriptors Computed from Structure

Canonical SMILES:

C#CCN(C1CCCCC1)C(=O)CC2C(=O)NCC[NH+]2CCC3=CC=CC=C3

Isomeric SMILES

C#CCN(C1CCCCC1)C(=O)C[C@@H]2C(=O)NCC[NH+]2CCC3=CC=CC=C3

InChI

InChI=1S/C23H31N3O2/c1-2-15-26(20-11-7-4-8-12-20)22(27)18-21-23(28)24-14-17-25(21)16-13-19-9-5-3-6-10-19/h1,3,5-6,9-10,20-21H,4,7-8,11-18H2,(H,24,28)/p+1/t21-/m1/s1